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magnesium 2,3-di(nonyl)naphthalene-1-sulfonate

magnesium 2,3-di(nonyl)naphthalene-1-sulfonate

Systemtic Name:magnesium 2,3-di(nonyl)naphthalene-1-sulfonate
Openeye Name:magnesium 2,3-di(nonyl)naphthalene-1-sulfonate
CAS Name:magnesium 2,3-di(nonyl)-1-naphthalenesulfonate
IUPAC Name:magnesium 2,3-di(nonyl)naphthalene-1-sulfonate
Traditional Name:magnesium 2,3-di(nonyl)naphthalene-1-sulfonate
Formula: C56H86MgO6S2
MolecularWeight: 943.71344
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC2=CC=CC=C2C(=C1CCCCCCCCC)S(=O)(=O)[O-].CCCCCCCCCC1=CC2=CC=CC=C2C(=C1CCCCCCCCC)S(=O)(=O)[O-].[Mg+2]


Isomeric SMILES

CCCCCCCCCC1=CC2=CC=CC=C2C(=C1CCCCCCCCC)S(=O)(=O)[O-].CCCCCCCCCC1=CC2=CC=CC=C2C(=C1CCCCCCCCC)S(=O)(=O)[O-].[Mg+2]


InChI

InChI=1S/2C28H44O3S.Mg/c2*1-3-5-7-9-11-13-15-19-24-23-25-20-17-18-22-27(25)28(32(29,30)31)26(24)21-16-14-12-10-8-6-4-2;/h2*17-18,20,22-23H,3-16,19,21H2,1-2H3,(H,29,30,31);/q;;+2/p-2


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